P032-1975 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one

P032-1975 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
P032-1975 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P032-1975
2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P032-1975

Molecular Formula

C23H21N5O3 (C23 H21 N5 O3)

Compound Name

2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H,3H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one

IUPAC name

2-[2-(23-dihydro-1H-indol-1-yl)-2-oxoethyl]-7-(methoxymethyl)-5-phenyl-2H3H-[124]triazolo[43-c]pyrimidin-3-one

SMILES

COCC(N=C(c1ccccc1)N12)=CC2=NN(CC(N(CC2)c3c2cccc3)=O)C1=O

InChI

InChI=1S/C23H21N5O3/c1-31-15-18-13-20-25-27(14-21(29)26-12-11-16-7-5-6-10-19(16)26)23(30)28(20)22(24-18)17-8-3-2-4-9-17/h2-10,13H,11-12,14-15H2,1H3

InChI Key

RHQDTKPLDWNWGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559282

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.387

Distribution Coefficient, logD

2.366

Water Solubility, LogSw

-2.44

Polar Surface Area

66.178

Acid Dissociation Constant (pKa)

17.32

Base Dissociation Constant (pKb)

6.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

P032-1975 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with P032-1975 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P032-1975?
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What is the minimum amount of P032-1975 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P032-1975
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P032-1975
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P032-1975 available by request